1-(4-methoxyphenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-4-carboxamide Openeye Name: N-(2-allylsulfanylphenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-(prop-2-enylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-4-carboxamide Traditional Name: N-[2-(allylthio)phenyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SCC=C

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=C3SCC=C

InChI

InChI=1S/C22H26N2O4S2/c1-3-16-29-21-7-5-4-6-20(21)23-22(25)17-12-14-24(15-13-17)30(26,27)19-10-8-18(28-2)9-11-19/h3-11,17H,1,12-16H2,2H3,(H,23,25)